HRID810661

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID962

Water

H2O

HCID8857

Ethyl acetate

C4H8O2

HCID8871

2(1H)-Pyridinone

C5H5NO

HCID31275

1,4-Dioxane

C4H8O2

结构：CC1(C)Oc2ccc([N+](=O)[O-])cc2C2OC21CNC(=O)C(F)(F)F

HCID19386922

未命名化合物

PRODUCTS

生成物

结构：CC1(C)Oc2ccc([N+](=O)[O-])cc2C(n2ccccc2=O)C1(O)CNC(=O)C(F)(F)F

HCID19387114

未命名化合物

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-c262df300be94c56abe7387747deef66
来源数据集: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D
来源说明: Test data from https://doi.org/10.1039/C8SC04228D

反应 SMILES

[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[CH:9]1[C:10]([CH2:16][NH:17][C:18]([C:19]([F:20])([F:21])[F:22])=[O:23])([C:11]([CH3:13])([CH3:14])[O:12]2)[O:15]1.[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[OH2:32].[nH:25]1[c:26](=[O:31])[cH:27][cH:28][cH:29][cH:30]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]2[c:8]([cH:24]1)[CH:9]([n:25]1[c:26](=[O:31])[cH:27][cH:28][cH:29][cH:30]1)[C:10]([OH:15])([CH2:16][NH:17][C:18]([C:19]([F:20])([F:21])[F:22])=[O:23])[C:11]([CH3:13])([CH3:14])[O:12]2